N-(azetidin-3-yl)-4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine

C11H19N5O2 — CID 66213927

IUPACN-(azetidin-3-yl)-4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine
SMILESCCCN(c1nc(OC)nc(OC)n1)C1CNC1
InChIInChI=1S/C11H19N5O2/c1-4-5-16(8-6-12-7-8)9-13-10(17-2)15-11(14-9)18-3/h8,12H,4-7H2,1-3H3
InChIKeyASHXXEOXIYZAPH-UHFFFAOYSA-N
MW253.31 g/mol
LogP0.08
Rot. Bonds6

About N-(azetidin-3-yl)-4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine

N-(azetidin-3-yl)-4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine (PubChem CID 66213927) has the molecular formula C11H19N5O2 and a molecular weight of 253.31 g/mol. Its IUPAC name is N-(azetidin-3-yl)-4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-(azetidin-3-yl)-4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine
PubChem CID66213927
Molecular FormulaC11H19N5O2
Molecular Weight253.31 g/mol
Exact Mass253.15
IUPAC NameN-(azetidin-3-yl)-4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine
SMILESCCCN(c1nc(OC)nc(OC)n1)C1CNC1
InChIInChI=1S/C11H19N5O2/c1-4-5-16(8-6-12-7-8)9-13-10(17-2)15-11(14-9)18-3/h8,12H,4-7H2,1-3H3
InChIKeyASHXXEOXIYZAPH-UHFFFAOYSA-N
XLogP0.08
TPSA72.40 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 50.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

2-N-cyclopropyl-6-methoxy-2-N-propyl-1,3,5-triazine-2,4-diamine
CID 80775722
2-N-cyclopropyl-4-N-ethyl-6-methoxy-2-N-propyl-1,3,5-triazine-2,4-diamine
CID 80774290
N-(azetidin-3-yl)-6-methoxy-N-propylpyridin-2-amine
CID 66214329
N-(azetidin-3-yl)-2,6-dimethyl-N-propylpyrimidin-4-amine
CID 66214933
N-(2-bromoethyl)-N-cyclopentyl-4,6-dimethoxy-1,3,5-triazin-2-amine
CID 80669323
N-(azetidin-3-yl)-7-methoxy-N-propylisoquinolin-1-amine
CID 106540822
methyl 6-[azetidin-3-yl(propyl)amino]pyrazine-2-carboxylate
CID 66458156
N-(azetidin-3-yl)-3-cyclopropyl-N-propyl-1,2,4-thiadiazol-5-amine
CID 66213937
N-(azetidin-3-yl)-3-propan-2-yl-N-propyl-1,2,4-thiadiazol-5-amine
CID 66213928
N-(azetidin-3-yl)-3-methyl-N-propylpyrazin-2-amine
CID 83062619
N-(azetidin-3-yl)-N-propyl-1,2,4-thiadiazol-5-amine
CID 66214743
2-N-cyclopropyl-6-ethoxy-2-N,4-N-dipropyl-1,3,5-triazine-2,4-diamine
CID 80774888

Frequently Asked Questions

What is the IUPAC name of N-(azetidin-3-yl)-4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine?
The IUPAC name of N-(azetidin-3-yl)-4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine (CID 66213927) is N-(azetidin-3-yl)-4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine.
What is the SMILES notation for N-(azetidin-3-yl)-4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine?
The canonical SMILES for N-(azetidin-3-yl)-4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine is CCCN(c1nc(OC)nc(OC)n1)C1CNC1.
What is the InChIKey of N-(azetidin-3-yl)-4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine?
The InChIKey is ASHXXEOXIYZAPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O2/c1-4-5-16(8-6-12-7-8)9-13-10(17-2)15-11(14-9)18-3/h8,12H,4-7H2,1-3H3.
What are the key properties of N-(azetidin-3-yl)-4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine?
N-(azetidin-3-yl)-4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine has a molecular weight of 253.31 g/mol, XLogP of 0.08, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(azetidin-3-yl)-4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 66213927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).